| SpectraBase Compound ID | 25fPc2PwcYU |
|---|---|
| InChI | InChI=1S/C11H16Cl2O4/c1-2-3-7-16-10(14)5-4-6-11(15)17-8-9(12)13/h2,9H,1,3-8H2 |
| InChIKey | JUJMHWHBMMRXNP-UHFFFAOYSA-N |
| Mol Weight | 283.15 g/mol |
| Molecular Formula | C11H16Cl2O4 |
| Exact Mass | 282.042564 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | AhUQ14mRnQV |
|---|---|
| Name | Glutaric acid, 2,2-dichloroethyl but-3-en-1-yl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.042564391 u |
| Formula | C11H16Cl2O4 |
| InChI | InChI=1S/C11H16Cl2O4/c1-2-3-7-16-10(14)5-4-6-11(15)17-8-9(12)13/h2,9H,1,3-8H2 |
| InChIKey | JUJMHWHBMMRXNP-UHFFFAOYSA-N |
| SMILES | C(CCC(OCC(Cl)Cl)=O)C(OCCC=C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.952009 |